COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK420058
Chemical Name: 2-{[(2E)-3-(4-nitrophenyl)prop-2-enoyl]amino}-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: CCCC1CCc2c(C1)sc(c2C(=O)N)NC(=O)/C=C/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 413.5
Empirical Formula: C21H23N3O4S

Physical State: Dry powder
Available Amount: 358 mg

Lipinsky:
logP: 6.822
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 146
Number of rings: 3

     

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